Benzo[a]pyrene-[d12]

General Information
Catalog: BLP-011036
CAS: 63466-71-7
Molecular Formula: C20D12
Molecular Weight: 264.38
Chemical Structure
Benzo[a]pyrene-[d12]
Synonyms 3,4-Benzopyrene-d12; Deuterated benzo[a]pyrene
IUPAC Name 1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[a]pyrene
Related CAS 50-32-8 (unlabelled)
Canonical SMILES C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3
InChI InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
InChI Key FMMWHPNWAFZXNH-AQZSQYOVSA-N
Boiling Point 495°C (lit.)
Melting Point 177-180°C (lit.)
Purity 99% by CP; 98% atom D

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